3-(4-fluoranyl-2-nitro-phenyl)sulfanyl-5-phenyl-1H-1,2,4-triazole

Systemtic Name: 3-(4-fluoranyl-2-nitro-phenyl)sulfanyl-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-(4-fluoro-2-nitro-phenyl)sulfanyl-5-phenyl-1H-1,2,4-triazole CAS Name: 3-[(4-fluoro-2-nitrophenyl)thio]-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-(4-fluoro-2-nitrophenyl)sulfanyl-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-[(4-fluoro-2-nitro-phenyl)thio]-5-phenyl-1H-1,2,4-triazole Formula: C14H9FN4O2S MolecularWeight: 316.310263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C14H9FN4O2S/c15-10-6-7-12(11(8-10)19(20)21)22-14-16-13(17-18-14)9-4-2-1-3-5-9/h1-8H,(H,16,17,18)